SMILES:
C=C(C)C(C(=O)OC)N1C(=O)C(OC(=O)COc2ccccc2)C1SSc1nc2ccccc2s1Molecular Processing
Molecular formula
C24H22N2O6S3
Molecular weight
530.65
Exact mass
530.064
XLogP
4.31
TPSA
95.03
H-bond donors
0
H-bond acceptors
10
Rotatable bonds
10
Heavy atoms
35
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
136.14
Supplementary Information
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